Information card for entry 4313133

Structure parameters

• Formula: C47 H32 Ge4 O10 Ru5
• Calculated formula: C47 H32 Ge4 O10 Ru5
• SMILES: [Ru]123456([Ru]789%10([Ru]%11%12%131([Ru]1%142([Ru]37([Ge]9(c2ccccc2)c2ccccc2)([Ge]51c1ccccc1)([CH]%10%12%14)(C#[O])C#[O])([Ge]%11(c1ccccc1)c1ccccc1)(C#[O])(C#[O])[H]6%13)([Ge]48c1ccccc1)(C#[O])C#[O])(C#[O])C#[O])(C#[O])C#[O]
• Title of publication: Germanium-Rich Pentaruthenium Carbonyl Clusters Including Ru5(CO)11(μ-GePh2)4(μ5-C) and Its Reactions with Hydrogen
• Authors of publication: Richard D. Adams; Burjor Captain; Wei Fu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 1328 - 1333
• a: 13.464 ± 0.004 Å
• b: 13.616 ± 0.004 Å
• c: 15.985 ± 0.005 Å
• α: 82.001 ± 0.006°
• β: 65.677 ± 0.006°
• γ: 68.553 ± 0.006°
• Cell volume: 2485.2 ± 1.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0431
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.0731
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No